5-({4-[butyl(methyl)carbamoyl]phenoxy}methyl)-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({4-[butyl(methyl)carbamoyl]phenoxy}methyl)-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-({4-[butyl(methyl)carbamoyl]phenoxy}methyl)-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L083-1117 |
| Compound Name: | 5-({4-[butyl(methyl)carbamoyl]phenoxy}methyl)-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C22 H23 F N4 O3 S |
| Smiles: | CCCCN(C)C(c1ccc(cc1)OCc1nnc(C(Nc2ccccc2F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3126 |
| logD: | 3.3093 |
| logSw: | -3.5684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.259 |
| InChI Key: | GMVUYLDZDDBHML-UHFFFAOYSA-N |